Hydrochloric Acid → HCID 58124899, compound

HRID 172856Notes

Reaction equation

HRID 172856 reaction equation
[CH3:45][OH:46].[CH:1]([CH3:2])([CH3:3])[N:4]1[CH2:5][CH2:6][N:7]([C:37]([O:38][C:39]([CH3:40])([CH3:41])[CH3:42])=[O:43])[CH2:8][c:9]2[c:10](-[c:32]3[s:33][cH:34][cH:35][cH:36]3)[c:11]3[n:12]([c:29]2[C:30]1=[O:31])[CH2:13][CH2:14][c:15]1[cH:16][c:17]([O:27][CH3:28])[c:18](-[c:21]2[cH:22][n:23][cH:24][cH:25][cH:26]2)[cH:19][c:20]1-3.[ClH:44].[Na+:57].[O-:53][C:54]([OH:55])=[O:56].[O:47]1[CH2:48][CH2:49][O:50][CH2:51][CH2:52]1>>[CH:1]([CH3:2])([CH3:3])[N:4]1[CH2:5][CH2:6][NH:7][CH2:8][c:9]2[c:10](-[c:32]3[s:33][cH:34][cH:35][cH:36]3)[c:11]3[n:12]([c:29]2[C:30]1=[O:31])[CH2:13][CH2:14][c:15]1[cH:16][c:17]([O:27][CH3:28])[c:18](-[c:21]2[cH:22][n:23][cH:24][cH:25][cH:26]2)[cH:19][c:20]1-3

Participants

7

Reactant 6

HCID 313Hydrochloric AcidHCID 769Bicarbonate IonHCID 887MethanolHCID 923Sodium ionHCID 312751,4-DioxaneHCID 58124874HCID 58124874, compound

Product 1

HCID 58124899HCID 58124899, compound

Sources & evidence

ORD record
ord-05c2d981132a4e41af1dc0f58062b1d3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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